Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1NC1CCN(CC(O)CN2N=C(C3=C2CCN(C3)C(C)=O)C2=CC=C(Cl)C=C2)CC1

InChIKey

InChIKey=VUNHPSNPEWLYJU-UHFFFAOYSA-N

Formula

C29H36ClN5O3

Mass

538.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylpyrazole - Methoxyaniline - Aminophenyl ether - Anisole - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Phenoxy compound - Methoxybenzene - 4-aminopiperidine - Chlorobenzene - Alkyl aryl ether - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Acetamide - Tertiary aliphatic amine - Secondary alcohol - Tertiary amine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Ether - Carboxylic acid derivative - Secondary amine - Azacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.

External Descriptors

Not available

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